COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL415659
Chemical Name: 2-tert-butyl-5-[3,5-dibromo-4-(prop-2-en-1-yloxy)benzylidene]-2-methyl-1,3-dioxane-4,6-dione
Smiles: C=CCOc1c(Br)cc(cc1Br)/C=C/1\C(=O)OC(OC1=O)(C)C(C)(C)C

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Molecular Weight: 488.17
Empirical Formula: C19H20Br2O5

Physical State: Dry powder
Available Amount: 917 mg

Lipinsky:
logP: 4.064
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 61
Number of rings: 2

     

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